Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.39 |
| ▸ | S100A4 | P26447 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2815988 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL3572666 | 0.80 | ALDH1A1 (0.60) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL30168212 | 0.80 | ALDH1A1 (0.60) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL13630905 | 0.80 | TDP1 (0.53) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL30142204 | 0.79 | HSD17B10 (0.58) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL3586346 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL24900737 | 0.76 | ALDH1A1 (0.56) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL11341340 | 0.76 | TDP1 (0.56) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL27599828 | 0.75 | HSD17B10 (0.58) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL29883144 | 0.75 | ALDH1A1 (0.41) | ALDH1A1TDP1CYP3A4TSHRLMNA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115667264-A | Novel imidazo-pyrazine derivatives | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | disclosed |